Hydrochloric Acid → HCID 10459964, compound

HRID 1220015Notes

Reaction equation

HRID 1220015 reaction equation
[CH:10]1([CH2:15][C:16](=[O:17])[Cl:18])[CH2:11][CH2:12][CH2:13][CH2:14]1.[CH:1]([N:2]([CH2:3][CH3:4])[CH:5]([CH3:6])[CH3:7])([CH3:8])[CH3:9].[Cl:53][CH2:54][Cl:55].[ClH:19].[F:20][C:21]([c:22]1[cH:23][c:24]([S:32](=[O:33])(=[O:34])[NH:35][c:36]2[s:37][c:38]3[c:43]([n:44]2)[CH2:42][CH2:41][NH2+:40][CH2:39]3)[cH:25][c:26]([C:28]([F:29])([F:30])[F:31])[cH:27]1)([F:45])[F:46].[Na+:52].[S:47](=[O:48])(=[O:49])([OH:50])[O-:51]>>[CH:10]1([CH2:15][C:16](=[O:17])[N:40]2[CH2:39][c:38]3[s:37][c:36]([NH:35][S:32]([c:24]4[cH:23][c:22]([C:21]([F:20])([F:45])[F:46])[cH:27][c:26]([C:28]([F:29])([F:30])[F:31])[cH:25]4)(=[O:33])=[O:34])[n:44][c:43]3[CH2:42][CH2:41]2)[CH2:11][CH2:12][CH2:13][CH2:14]1

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 923Sodium ionHCID 6344DichloromethaneHCID 61778Sulfate, hydrogenHCID 81531DiisopropylethylamineHCID 3485182Cyclopentylacetyl chlorideHCID 153793972HCID 153793972, compound

Product 1

HCID 10459964HCID 10459964, compound

Sources & evidence

ORD record
ord-c3134a9c96584c7d8e6c96482408083c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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